[(2S)-1-[(2S)-2-ethylpiperidin-1-yl]-1-oxidanylidene-propan-2-yl]-(2-methylphenyl)azanium

Systemtic Name: [(2S)-1-[(2S)-2-ethylpiperidin-1-yl]-1-oxidanylidene-propan-2-yl]-(2-methylphenyl)azanium Openeye Name: [(1S)-2-[(2S)-2-ethyl-1-piperidyl]-1-methyl-2-oxo-ethyl]-(o-tolyl)ammonium CAS Name: [(2S)-1-[(2S)-2-ethyl-1-piperidinyl]-1-oxopropan-2-yl]-(2-methylphenyl)ammonium IUPAC Name: [(2S)-1-[(2S)-2-ethylpiperidin-1-yl]-1-oxopropan-2-yl]-(2-methylphenyl)azanium Traditional Name: [(1S)-2-[(2S)-2-ethylpiperidino]-2-keto-1-methyl-ethyl]-(o-tolyl)ammonium Formula: C17H27N2O+ MolecularWeight: 275.40908

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)C(C)[NH2+]C2=CC=CC=C2C

Isomeric SMILES

CC[C@H]1CCCCN1C(=O)[C@H](C)[NH2+]C2=CC=CC=C2C

InChI

InChI=1S/C17H26N2O/c1-4-15-10-7-8-12-19(15)17(20)14(3)18-16-11-6-5-9-13(16)2/h5-6,9,11,14-15,18H,4,7-8,10,12H2,1-3H3/p+1/t14-,15-/m0/s1